CS-0256020
tert-Butyl ((1-((2,4-dichloropyrimidin-5-yl)methyl)piperidin-2-yl)methyl)carbamate
Manufacturer: ChemScene
CAS Number: 1420899-77-9
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Purity
97%
MDL No
None
Storage
-20°C, sealed storage, away from moisture and light
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₆H₂₄Cl₂N₄O₂
Molecular Weight
375.29
Synonyms
Carbamic acid, N-[[1-[(2,4-dichloro-5-pyrimidinyl)methyl]-2-piperidinyl]methyl]-, 1,1-dimethylethyl ester
SMILES
O=C(NCC1N(CCCC1)CC2=CN=C(N=C2Cl)Cl)OC(C)(C)C
Tpsa
67.35
Logp
3.6626
H Acceptors
5
H Donors
1
Rotatable Bonds
4
SAFETY INFORMATION
Pictograms
Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
Hazard Statements
Precautionary Statements
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
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Purity: 97%
MDL No: None
Storage: -20°C, sealed storage, away from moisture and light
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₆H₂₄Cl₂N₄O₂
Molecular Weight: 375.29
Synonyms: Carbamic acid, N-[[1-[(2,4-dichloro-5-pyrimidinyl)methyl]-2-piperidinyl]methyl]-, 1,1-dimethylethyl ester
SMILES: O=C(NCC1N(CCCC1)CC2=CN=C(N=C2Cl)Cl)OC(C)(C)C
Tpsa: 67.35
Logp: 3.6626
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 4
Purity:
97%
MDL No:
None
Storage:
-20°C, sealed storage, away from moisture and light
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₆H₂₄Cl₂N₄O₂
Molecular Weight:
375.29
Synonyms:
Carbamic acid, N-[[1-[(2,4-dichloro-5-pyrimidinyl)methyl]-2-piperidinyl]methyl]-, 1,1-dimethylethyl ester
SMILES:
O=C(NCC1N(CCCC1)CC2=CN=C(N=C2Cl)Cl)OC(C)(C)C
Tpsa:
67.35
Logp:
3.6626
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
4
Purity: 97%
MDL No: None
Storage: -20°C, sealed storage, away from moisture and light
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₆H₂₂Cl₂N₄O₄
Molecular Weight: 405.28
Synonyms: 1,2-Piperazinedicarboxylic acid, 4-[(2,4-dichloro-5-pyrimidinyl)methyl]-, 1-(1,1-dimethylethyl) 2-methyl ester
SMILES: O=C(N1CCN(CC1C(OC)=O)CC2=CN=C(N=C2Cl)Cl)OC(C)(C)C
Tpsa: 84.86
Logp: 2.3777
H Acceptors: 7
H Donors: 0
Rotatable Bonds: 3
Purity:
97%
MDL No:
None
Storage:
-20°C, sealed storage, away from moisture and light
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₆H₂₂Cl₂N₄O₄
Molecular Weight:
405.28
Synonyms:
1,2-Piperazinedicarboxylic acid, 4-[(2,4-dichloro-5-pyrimidinyl)methyl]-, 1-(1,1-dimethylethyl) 2-methyl ester
SMILES:
O=C(N1CCN(CC1C(OC)=O)CC2=CN=C(N=C2Cl)Cl)OC(C)(C)C
Tpsa:
84.86
Logp:
2.3777
H Acceptors:
7
H Donors:
0
Rotatable Bonds:
3
Purity: 95%
MDL No: None
Storage: -20°C, sealed storage, away from moisture and light
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₁₈Cl₂N₄O₂
Molecular Weight: 333.21
Synonyms: Tert-butyl 3-(2,6-dichloropyrimidin-4-ylamino)pyrrolidine-1-carboxylate
SMILES: O=C(N1CCC(C1)NC2=CC(Cl)=NC(Cl)=N2)OC(C)(C)C
Tpsa: 67.35
Logp: 3.2047
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 2
Purity:
95%
MDL No:
None
Storage:
-20°C, sealed storage, away from moisture and light
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₈Cl₂N₄O₂
Molecular Weight:
333.21
Synonyms:
Tert-butyl 3-(2,6-dichloropyrimidin-4-ylamino)pyrrolidine-1-carboxylate
SMILES:
O=C(N1CCC(C1)NC2=CC(Cl)=NC(Cl)=N2)OC(C)(C)C
Tpsa:
67.35
Logp:
3.2047
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
2
Purity: 98%
MDL No: None
Storage: 4°C, protect from light
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₄Cl₂IN
Molecular Weight: 323.95
Synonyms: None
SMILES: ClC1=NC2=C(C=C(C=C2C=C1)Cl)I
Tpsa: 12.89
Logp: 4.1462
H Acceptors: 1
H Donors: 0
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
4°C, protect from light
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₄Cl₂IN
Molecular Weight:
323.95
Synonyms:
None
SMILES:
ClC1=NC2=C(C=C(C=C2C=C1)Cl)I
Tpsa:
12.89
Logp:
4.1462
H Acceptors:
1
H Donors:
0
Rotatable Bonds:
0